SCHEMBL6177786

SCHEMBL6177786

CCN(CC)CCCN1C(=O)C(=O)c2cc(Cl)ccc21

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
ALDH2 P05091 4/20 0.55
ALDH3A1 P30838 4/20 0.55
HTR1A P08908 1/20 0.47
DRD3 P35462 1/20 0.47
OPRK1 P41145 1/20 0.47
HTR3A P46098 1/20 0.47
KCNH2 Q12809 1/20 0.47
GHSR Q92847 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
PIM1 P11309 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GABRA1 P14867 1/20 0.45
GABRG2 P18507 1/20 0.45
GABRB3 P28472 1/20 0.45
GABRA5 P31644 1/20 0.45
GABRA3 P34903 1/20 0.45
GABRA2 P47869 1/20 0.45
GABRA6 Q16445 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30892351 0.92 ALDH3A1 (0.58) ALDH1A1ALDH2ALDH3A1HTR1ADRD3
SCHEMBL6179832 0.92 ALDH3A1 (0.58) ALDH1A1ALDH2ALDH3A1HTR1ADRD3
SCHEMBL16046979 0.85 ALDH1A1 (0.62) ALDH1A1ALDH2ALDH3A1MEN1KMT2A
SCHEMBL16366714 0.83 ALDH1A1 (0.64) ALDH1A1ALDH2ALDH3A1MEN1KMT2A
SCHEMBL28533366 0.83 ALDH3A1 (0.67) ALDH1A1ALDH2ALDH3A1CES1CDC25A
SCHEMBL3025055 0.82 CES1 (0.65) ALDH1A1ALDH2ALDH3A1MEN1KMT2A
SCHEMBL29281825 0.82 UCHL3 (0.45) ALDH1A1ALDH2ALDH3A1HTR1ADRD3
SCHEMBL29281830 0.82 UCHL3 (0.45) ALDH1A1ALDH2ALDH3A1HTR1ADRD3
SCHEMBL30892344 0.82 UCHL3 (0.45) ALDH1A1ALDH2ALDH3A1HTR1ADRD3
SCHEMBL29011260 0.82 ALDH3A1 (0.62) ALDH1A1ALDH2ALDH3A1MEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1105376-B1 OXINDOLE DERIVATIVES AS GROWTH HORMONE RELEASERS SUMITOMO PHARMA (JP) 2005-02-09 EP disclosed
US-6576656-B1 Such as 1-(2-diethylaminoethyl)-4-trifluoromethyl-6-carbamoyl-3-hydroxy-3-(2 -chlorophenyl)oxindole; growth hormone releaser SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2003-06-10 US disclosed